2-amino-N-benzyl-2-phenylacetamide

• ChemBase ID: 237669
• Molecular Formular: C15H16N2O
• Molecular Mass: 240.30034
• Monoisotopic Mass: 240.12626314
• SMILES: C(=O)(NCc1ccccc1)C(c1ccccc1)N
• Canonical SMILES: NC(c1ccccc1)C(=O)NCc1ccccc1
• InChI: InChI=1S/C15H16N2O/c16-14(13-9-5-2-6-10-13)15(18)17-11-12-7-3-1-4-8-12/h1-10,14H,11,16H2,(H,17,18)
• InChIKey: ANPFFDAQFQPIHE-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: 2-amino-N-benzyl-2-phenylacetamide
• IUPAC Traditional name: 2-amino-N-benzyl-2-phenylacetamide
• Synonyms: 2-amino-N-benzyl-2-phenylacetamide

Database IDs

• MDL Number: MFCD09927969
• PubChem SID: 164293579
• PubChem CID: 13328815

CALCULATED PROPERTIES

• Acid pKa: 15.429573
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -0.24644251
• LogD (pH = 7.4): 1.4283916
• Log P: 1.9301604
• Molar Refractivity: 71.6928 cm^3
• Polarizability: 28.201223 Å^3
• Polar Surface Area: 55.12 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Hydrophobicity(logP): 1.889

Product Information

• Purity: 95%